3-[(2-chlorophenyl)methyl]-N-(4-methoxyphenyl)-1,3-diazinane-1-carbothioamide
Chemical Structure Depiction of
3-[(2-chlorophenyl)methyl]-N-(4-methoxyphenyl)-1,3-diazinane-1-carbothioamide
3-[(2-chlorophenyl)methyl]-N-(4-methoxyphenyl)-1,3-diazinane-1-carbothioamide
Compound characteristics
| Compound ID: | K788-3605 |
| Compound Name: | 3-[(2-chlorophenyl)methyl]-N-(4-methoxyphenyl)-1,3-diazinane-1-carbothioamide |
| Molecular Weight: | 375.92 |
| Molecular Formula: | C19 H22 Cl N3 O S |
| Smiles: | COc1ccc(cc1)NC(N1CCCN(Cc2ccccc2[Cl])C1)=S |
| Stereo: | ACHIRAL |
| logP: | 4.5985 |
| logD: | 4.5613 |
| logSw: | -4.5415 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 22.9609 |
| InChI Key: | LNGGEGCHRJMQDK-UHFFFAOYSA-N |